Geometry & MOs

Info

ID:

382626

PubChem CID:

134973898

Reduced:

NSiO3C19H31 (1)

Stoich.:

ABC3D19E31 (1)

Weight, g/mol:

419.194402

ΔHf, kcal/mol:

-168.47

Dipole, Da:

3.82

IP(EA), eV:

 -9.19(0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[(3R)-9-[(E)-but-1-enyl]-3-hydroxy-4-methyl-2,14-dioxa-10-azapentacyclo[6.5.1.01,5.06,10.09,13]tetradecan-3-yl]-5-hydroxy-4-methoxy-3-methylfuran-2-one

Drug info:

PubChemData

Smile

CC/C=C/C12C3CCN1C4CC2OC3(C4C(C)C=O)O[Si](C)(C)C

DOS

IR

Vibrations